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1,2-Bis(8-acetoxy-3-n-butylquinolin-7-yl)ethane
SpectraBase Compound ID KnaMqKlHSbT
InChI InChI=1S/C32H36N2O4/c1-5-7-9-23-17-27-15-13-25(31(37-21(3)35)29(27)33-19-23)11-12-26-14-16-28-18-24(10-8-6-2)20-34-30(28)32(26)38-22(4)36/h13-20H,5-12H2,1-4H3
InChIKey MEZYKASYWDHTKB-UHFFFAOYSA-N
Mol Weight 512.7 g/mol
Molecular Formula C32H36N2O4
Exact Mass 512.267508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Je91mKyRMtw
Name 1,2-Bis(8-acetoxy-3-n-butylquinolin-7-yl)ethane
Alternate Name(s) 1,2-Bis(8-hydroxy-3-n-butylquinolin-7-yl)ethane 7-{2-[8-(acetyloxy)-3-butyl-7-quinolinyl]ethyl}-3-butyl-8-quinolinyl acetate
Comments Less than 3 mono-isotopic peaks
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Formula C32H36N2O4
InChI InChI=1S/C32H36N2O4/c1-5-7-9-23-17-27-15-13-25(31(37-21(3)35)29(27)33-19-23)11-12-26-14-16-28-18-24(10-8-6-2)20-34-30(28)32(26)38-22(4)36/h13-20H,5-12H2,1-4H3
InChIKey MEZYKASYWDHTKB-UHFFFAOYSA-N
Molecular Weight 512.650 g/mol
SMILES C(Cc1ccc2cc(cnc2c1OC(=O)C)CCCC)c1ccc2cc(cnc2c1OC(=O)C)CCCC
SPLASH splash10-03di-0090000000-8fb3ba871459180d1a97
Source of Spectrum QE-5-54-1
Wiley ID 843964